{"id":"W2737879784","doi":"10.1016/bs.mie.2017.06.034","title":"Measurement of Kinetic Isotope Effects by Continuously Monitoring Isotopologue Ratios Using NMR Spectroscopy","year":2017,"lang":"en","type":"article","venue":"Methods in enzymology on CD-ROM/Methods in enzymology","topic":"Advanced NMR Techniques and Applications","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":false,"ca_institutions":"Simon Fraser University","funders":"","keywords":"Isotopologue; Natural abundance; Deuterium; Isotope; Chemistry; Analytical Chemistry (journal); Instrumentation (computer programming); Deuterium NMR; Kinetic energy; Nuclear magnetic resonance spectroscopy; Kinetic isotope effect; Spectroscopy; Mass spectrometry; Chromatography; Nuclear physics; Physics; Molecule; Computer science; Stereochemistry; Organic chemistry","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001049729,0.0007763969,0.0004966744,0.0004919973,0.0004084259,0.001007888,0.000829826,0.0007239532,0.001469073],"category_scores_gemma":[0.002087465,0.000512392,0.0002840975,0.0006264825,0.0006599447,0.001445805,0.0004367988,0.001899446,0.0006117116],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000636844,"about_ca_system_score_gemma":0.0005143042,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008979761,"about_ca_topic_score_gemma":0.001602146,"domain_scores_codex":[0.9993155,0.0001256968,0.00004386753,0.0001965429,0.0002251427,0.00009332658],"domain_scores_gemma":[0.9986932,0.0004948429,0.0001983864,0.0002314277,0.0002432179,0.0001389937],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0002424379,0.0000536312,0.0002726499,0.00003305641,0.00001205205,0.00002254981,0.00002928901,0.00009558834,0.9944946,0.0001964429,0.0001098893,0.004437746],"study_design_scores_gemma":[0.00001055491,0.00008195524,0.0006025792,0.000003167686,0.00001520078,0.00003694506,0.00001132687,0.00177674,0.9968216,0.00008848158,0.0005394571,0.00001196676],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"methods","genre_scores_codex":[0.8691177,0.002354171,0.1192148,0.0003576155,0.0003197463,0.0001636827,0.001213623,0.001443336,0.005815305],"genre_scores_gemma":[0.9016251,0.002423609,0.08831263,0.0003399204,0.0000833462,0.0002348142,0.001032924,0.0005306199,0.005417116],"genre_candidate":"methods","genre_consensus":null,"teacher_disagreement_score":0.001469073,"threshold_uncertainty_score":0.005551577,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.06121601481424106,"score_gpt":0.4419637386118904,"score_spread":0.3807477237976494,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}